COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585502
Chemical Name: (3aR,4R,4aR,7aS,8R,8aR)-3-[4-(benzyloxy)-3-methoxyphenyl]-6-[2-(dimethylamino)ethyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1cc(ccc1OCc1ccccc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CCN(C)C

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Molecular Weight: 489.57
Empirical Formula: C28H31N3O5

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 2.904
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 80
Number of rings: 6

     

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